(2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone

C19H16O3 — CID 146006285

IUPAC(2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone
SMILESCOc1ccc(OC)c(C(=O)c2cccc3ccccc23)c1
InChIInChI=1S/C19H16O3/c1-21-14-10-11-18(22-2)17(12-14)19(20)16-9-5-7-13-6-3-4-8-15(13)16/h3-12H,1-2H3
InChIKeyNSKGHFACOFTHAV-UHFFFAOYSA-N
MW292.33 g/mol
LogP4.09
Rot. Bonds4

About (2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone

(2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone (PubChem CID 146006285) has the molecular formula C19H16O3 and a molecular weight of 292.33 g/mol. Its IUPAC name is (2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone.

Molecular Properties

Compound Name(2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone
PubChem CID146006285
Molecular FormulaC19H16O3
Molecular Weight292.33 g/mol
Exact Mass292.11
IUPAC Name(2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone
SMILESCOc1ccc(OC)c(C(=O)c2cccc3ccccc23)c1
InChIInChI=1S/C19H16O3/c1-21-14-10-11-18(22-2)17(12-14)19(20)16-9-5-7-13-6-3-4-8-15(13)16/h3-12H,1-2H3
InChIKeyNSKGHFACOFTHAV-UHFFFAOYSA-N
XLogP4.09
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2,7-dimethoxynaphthalen-1-yl)-naphthalen-1-ylmethanone
CID 139085652
(2,3-dimethoxyphenyl)-(2,5-dimethoxyphenyl)methanone
CID 69347574
(2-chlorophenyl)-(2,5-dimethoxyphenyl)methanone
CID 623894
(2,5-dimethoxyphenyl)-(2-iodophenyl)methanone
CID 15888023
[6-methoxy-5-[2-methoxy-6-(naphthalene-1-carbonyl)naphthalen-1-yl]naphthalen-2-yl]-naphthalen-1-ylmethanone
CID 101460356
(3-chloro-2-fluorophenyl)-(2,5-dimethoxyphenyl)methanone
CID 64714149
(2-bromo-5-methoxyphenyl)-(2-methoxyphenyl)methanone
CID 105079993
1-(3-methoxyphenyl)-2-naphthalen-1-ylethane-1,2-dione
CID 56956967
(2,4-dimethoxyphenyl)-pyren-1-ylmethanone
CID 15505944
isoquinolin-5-yl-(2-methoxy-5-methylphenyl)methanone
CID 114970995
(NZ)-N-[1-(2,5-dimethoxyphenyl)-2-naphthalen-1-yloxyethylidene]hydroxylamine
CID 122179760
(2,3-dimethoxyphenyl)-(2-methoxyphenyl)methanone
CID 67592746

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone?
The IUPAC name of (2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone (CID 146006285) is (2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone.
What is the SMILES notation for (2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone?
The canonical SMILES for (2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone is COc1ccc(OC)c(C(=O)c2cccc3ccccc23)c1.
What is the InChIKey of (2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone?
The InChIKey is NSKGHFACOFTHAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16O3/c1-21-14-10-11-18(22-2)17(12-14)19(20)16-9-5-7-13-6-3-4-8-15(13)16/h3-12H,1-2H3.
What are the key properties of (2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone?
(2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone has a molecular weight of 292.33 g/mol, XLogP of 4.09, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethoxyphenyl)-naphthalen-1-ylmethanone is sourced from PubChem (CID 146006285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).